SCHEMBL14925835

SCHEMBL14925835

COc1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ PGR P06401 7/20 0.51
▸ NR3C1 P04150 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ FFAR1 O14842 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KEAP1 Q14145 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ PTGES O14684 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ HSD17B1 P14061 1/20 0.41
▸ HSD17B2 P37059 1/20 0.41
▸ TP53 P04637 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15315177 0.92 HTT (0.62) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL2623415 0.92 HTT (0.62) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12938531 0.92 HTT (0.62) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12018970 0.89 PGR (0.46) HTTSMN1; SMN2PGRALDH1A1FFAR1
SCHEMBL12012643 0.88 HTT (0.68) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12012655 0.87 HTT (0.59) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12012658 0.87 HTT (0.62) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL2623417 0.87 HTT (0.56) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12012647 0.85 HTT (0.51) HTTSMN1; SMN2TDP1L3MBTL1PGR
SCHEMBL12012660 0.84 HTT (0.52) HTTSMN1; SMN2TDP1L3MBTL1PGR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130112927-A1 COMPOSITION, AND FILM, CHARGE TRANSPORTING LAYER, ORGANIC ELECTROLUMINESCENCE DEVICE USING THE COMPOSITION, AND METHOD FOR FORMING CHARGE TRANSPORTING LAYER FUJIFILM CORPORATION (JP) 2013-05-09 — — US disclosed
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